COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374986
Chemical Name: (5E)-5-{(2Z)-2-[5-chloro-3-(2-hydroxyethyl)-1,3-benzothiazol-2(3H)-ylidene]ethylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCn1/c(=C/C=C\2/SC(=S)N(C2=O)CC)/sc2c1cc(Cl)cc2

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Molecular Weight: 398.96
Empirical Formula: C16H15ClN2O2S3

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 1.063
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 126
Number of rings: 3

     

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